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1,4-di(1H-pyrazol-4-yl)benzene

Catalog Number ACM1036248620-2
CAS 1036248-62-0
Synonyms 1,4-benzenedi(4'-pyrazolyl)
IUPAC Name 4-[4-(1H-pyrazol-4-yl)phenyl]-1H-pyrazole
Molecular Weight 210.23
Molecular Formula C12H10N4
InChI RUGLQPNWHSDVER-UHFFFAOYSA-N
InChI Key InChI=1S/C12H10N4/c1-2-10(12-7-15-16-8-12)4-3-9(1)11-5-13-14-6-11/h1-8H,(H,13,14)(H,15,16)
Melting Point >360 °C
Purity 96%
Appearance Brown powder
Complexity 201
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 0
Exact Mass 210.090546336g/mol
Formal Charge 0
Heavy Atom Count 16
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
Isomeric SMILES C1=CC(=CC=C1C2=CNN=C2)C3=CNN=C3
Monoisotopic Mass 210.090546336g/mol
Rotatable Bond Count 2
Topological Polar Surface Area 57.4Ų

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